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Details

Stereochemistry ACHIRAL
Molecular Formula C3H3Cl3O
Molecular Weight 161.414
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 1,1,1-TRICHLOROACETONE

SMILES

CC(=O)C(Cl)(Cl)Cl

InChI

InChIKey=SMZHKGXSEAGRTI-UHFFFAOYSA-N
InChI=1S/C3H3Cl3O/c1-2(7)3(4,5)6/h1H3

HIDE SMILES / InChI

Molecular Formula C3H3Cl3O
Molecular Weight 161.414
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Investigation of the behaviour of haloketones in water samples.
2001 Aug
Formation of disinfection by-products in chlorinated swimming pool water.
2002 Jan
Correlations between differential absorbance and the formation of individual DBPs.
2002 Jul
DBP levels in chlorinated drinking water: effect of humic substances.
2004 Apr-May
Dermal uptake of chloroform and haloketones during bathing.
2005 Jul
Degradation of drinking water disinfection byproducts by synthetic goethite and magnetite.
2005 Nov 1
Effects of dissolved oxygen and iron aging on the reduction of trichloronitromethane, trichloracetonitrile, and trichloropropanone.
2007 Feb
Degradation of disinfection byproducts by carbonate green rust.
2007 Mar 1
Evaluation of functional groups responsible for chloroform formation during water chlorination using compound specific isotope analysis.
2008 Nov 1
Disinfection byproduct formation and fractionation behavior of natural organic matter surrogates.
2009 Aug 1
Formation of chlorinated disinfection by-products in viticulture.
2009 Jul
Screening analysis of volatile organic contaminants in commercial inorganic coagulants used for drinking water treatment.
2009 Oct
Comparative study of the dissociative ionization of 1,1,1-trichloroethane using nanosecond and femtosecond laser pulses.
2010 Mar 17
Substance Class Chemical
Created
by admin
on Fri Dec 15 17:57:11 GMT 2023
Edited
by admin
on Fri Dec 15 17:57:11 GMT 2023
Record UNII
NW27ZG5LDA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
1,1,1-TRICHLOROACETONE
HSDB  
Systematic Name English
TRICHLOROMETHYL METHYL KETONE
Systematic Name English
1,1,1-TRICHLORO-2-PROPANONE
Systematic Name English
NSC-2645
Code English
1,1,1-TRICHLOROACETONE [HSDB]
Common Name English
2-PROPANONE, 1,1,1-TRICHLORO-
Systematic Name English
.ALPHA.,.ALPHA.,.ALPHA.-TRICHLOROACETONE
Common Name English
Code System Code Type Description
WIKIPEDIA
1,1,1-Trichloroacetone
Created by admin on Fri Dec 15 17:57:11 GMT 2023 , Edited by admin on Fri Dec 15 17:57:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID5021679
Created by admin on Fri Dec 15 17:57:11 GMT 2023 , Edited by admin on Fri Dec 15 17:57:11 GMT 2023
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NSC
2645
Created by admin on Fri Dec 15 17:57:11 GMT 2023 , Edited by admin on Fri Dec 15 17:57:11 GMT 2023
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PUBCHEM
13514
Created by admin on Fri Dec 15 17:57:11 GMT 2023 , Edited by admin on Fri Dec 15 17:57:11 GMT 2023
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CAS
918-00-3
Created by admin on Fri Dec 15 17:57:11 GMT 2023 , Edited by admin on Fri Dec 15 17:57:11 GMT 2023
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HSDB
7625
Created by admin on Fri Dec 15 17:57:11 GMT 2023 , Edited by admin on Fri Dec 15 17:57:11 GMT 2023
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FDA UNII
NW27ZG5LDA
Created by admin on Fri Dec 15 17:57:11 GMT 2023 , Edited by admin on Fri Dec 15 17:57:11 GMT 2023
PRIMARY